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4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)butanoic acid

4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)butanoic acid

Systemtic Name:4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)butanoic acid
Openeye Name:4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)butanoic acid
CAS Name:4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)butanoic acid
IUPAC Name:4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)butanoic acid
Traditional Name:4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)butyric acid
Formula: C19H20O6
MolecularWeight: 344.3585
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCC2=CC3=C(C=C2)OCO3)C(=O)O)OC


Isomeric SMILES

COC1=C(C=C(C=C1)C(CCC2=CC3=C(C=C2)OCO3)C(=O)O)OC


InChI

InChI=1S/C19H20O6/c1-22-15-8-5-13(10-17(15)23-2)14(19(20)21)6-3-12-4-7-16-18(9-12)25-11-24-16/h4-5,7-10,14H,3,6,11H2,1-2H3,(H,20,21)


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